2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine

C6H13N7O3 — CID 159586482

IUPAC2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine
SMILESC=O.NCC(=O)O.Nc1nc(N)nc(N)n1
InChIInChI=1S/C3H6N6.C2H5NO2.CH2O/c4-1-7-2(5)9-3(6)8-1;3-1-2(4)5;1-2/h(H6,4,5,6,7,8,9);1,3H2,(H,4,5);1H2
InChIKeyMJRJAUGZIYNYDM-UHFFFAOYSA-N
MW231.22 g/mol
LogP-2.54
Rot. Bonds1

About 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine

2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine (PubChem CID 159586482) has the molecular formula C6H13N7O3 and a molecular weight of 231.22 g/mol. Its IUPAC name is 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine
PubChem CID159586482
Molecular FormulaC6H13N7O3
Molecular Weight231.22 g/mol
Exact Mass231.11
IUPAC Name2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine
SMILESC=O.NCC(=O)O.Nc1nc(N)nc(N)n1
InChIInChI=1S/C3H6N6.C2H5NO2.CH2O/c4-1-7-2(5)9-3(6)8-1;3-1-2(4)5;1-2/h(H6,4,5,6,7,8,9);1,3H2,(H,4,5);1H2
InChIKeyMJRJAUGZIYNYDM-UHFFFAOYSA-N
XLogP-2.54
TPSA197.12 Ų
H-Bond Donors5
H-Bond Acceptors9
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.22
LogP ≤ 5-2.54
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 109

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Related Compounds

2-Aminoacetic acid;1,3,5-triazine-2,4,6-triamine
CID 19091153
2-aminoacetic acid;N-(4,6-diamino-1,3,5-triazin-2-yl)formamide
CID 19091154
2-[(4,6-Diamino-1,3,5-triazin-2-yl)amino]acetic acid
CID 53847074
2-[[4-Amino-6-(carboxymethylamino)-1,3,5-triazin-2-yl]amino]acetic acid
CID 67194114
2-Aminoacetic acid;1,3,5-triazine
CID 159767782
2-Aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine
CID 160651743
2-[2-(4,6-Diamino-1,3,5-triazin-2-yl)hydrazinyl]acetic acid
CID 129925686

Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine (CID 159586482) is 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine is C=O.NCC(=O)O.Nc1nc(N)nc(N)n1.
What is the InChIKey of 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine?
The InChIKey is MJRJAUGZIYNYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N6.C2H5NO2.CH2O/c4-1-7-2(5)9-3(6)8-1;3-1-2(4)5;1-2/h(H6,4,5,6,7,8,9);1,3H2,(H,4,5);1H2.
What are the key properties of 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine?
2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine has a molecular weight of 231.22 g/mol, XLogP of -2.54, 1 rotatable bonds, 5 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 159586482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).